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(E)-2-[(2,2-Dimethylhex-4-en-1-yl)oxy]isoindoline-1,3-dione
SpectraBase Compound ID 5cO5k5RkvB7
InChI InChI=1S/C16H19NO3/c1-4-5-10-16(2,3)11-20-17-14(18)12-8-6-7-9-13(12)15(17)19/h4-9H,10-11H2,1-3H3/b5-4+
InChIKey KKUJBRUDGPTGJM-SNAWJCMRSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Zl2TvOLhIj
Name (E)-2-[(2,2-Dimethylhex-4-en-1-yl)oxy]isoindoline-1,3-dione
Appearance Colorless oil
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Exact Mass 273.136493473 u
Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-4-5-10-16(2,3)11-20-17-14(18)12-8-6-7-9-13(12)15(17)19/h4-9H,10-11H2,1-3H3/b5-4+
InChIKey KKUJBRUDGPTGJM-SNAWJCMRSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/anie.201710895
Quality 213
Reported Formula C16H19NO3
SMILES C(ON1C(C2=C(C1=O)C=CC=C2)=O)C(C\C=C\C)(C)C
SPLASH splash10-0aos-9200000000-2afaf4bc1ae15849f0e3
Sample Comments Major
Source of Spectrum ACI-57-SM40-15n (DOI: 10.1002/anie.201710895)
Wiley ID 1890804